1 | // ----------------------------------------------------------------------------- |
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2 | // Include-Dateien |
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3 | // ----------------------------------------------------------------------------- |
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4 | |
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5 | #include <iostream> |
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6 | #include <fstream> |
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7 | #include <cstring> |
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8 | |
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9 | #include "a3_helix.hxx" |
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10 | #include "a3_ali.hxx" |
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11 | #include "a3_matrix.hxx" |
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12 | |
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13 | using std::cout; |
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14 | |
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15 | // ----------------------------------------------------------------------------- |
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16 | static str CleanHelix ( str hel ) |
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17 | // ----------------------------------------------------------------------------- |
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18 | { |
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19 | str heli = strdup(hel), |
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20 | ptr = heli; |
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21 | |
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22 | if (ptr) |
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23 | { |
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24 | int ch; |
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25 | |
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26 | while ((ch = *ptr) != 0) |
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27 | { |
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28 | if (ch == '<') *ptr = '['; |
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29 | if (ch == '>') *ptr = ']'; |
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30 | |
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31 | ptr++; |
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32 | } |
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33 | } |
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34 | |
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35 | return heli; |
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36 | } |
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37 | |
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38 | // ----------------------------------------------------------------------------- |
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39 | static int FindHelices ( str helix, |
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40 | int left, |
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41 | int right, |
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42 | A3Matrix &matrix ) |
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43 | // ----------------------------------------------------------------------------- |
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44 | { |
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45 | int error = 0, |
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46 | increment = 0, |
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47 | count = 0, |
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48 | last = -1, |
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49 | pos = 0; |
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50 | DArray mark(10,5,DARRAY_NOFREE); |
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51 | |
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52 | while (!error && (pos <= right)) |
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53 | { |
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54 | if (helix[pos] == '[') count++, increment = 1; |
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55 | else if ((helix[pos] == ']') && count) |
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56 | { |
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57 | if (increment > 0) |
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58 | { |
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59 | int back = pos - 1; |
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60 | |
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61 | while ((back >= left) && (helix[back] != '[')) back--; |
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62 | |
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63 | if (back < left) error = 2; |
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64 | else if (matrix.Set(pos - left,back - left,(vp)1) || |
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65 | matrix.Set(back - left,pos - left,(vp)1)) error = 3; |
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66 | { |
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67 | if (last < 0) last = mark.Add((vp)pos); |
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68 | else if ((back - (long)mark[last]) > 1) last = mark.Add((vp)pos); |
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69 | } |
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70 | } |
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71 | else if (increment < 0) |
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72 | { |
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73 | long back = (long)mark[last], |
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74 | backend = left, |
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75 | tmp = back; |
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76 | |
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77 | while (tmp--) if (matrix.Get(back - left,tmp - left)) break; |
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78 | |
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79 | back = tmp - 1; |
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80 | |
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81 | if (last > 0) backend = (long)mark[last - 1] + 1; |
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82 | |
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83 | while (back >= backend) |
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84 | { |
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85 | if (helix[back] == '[') |
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86 | { |
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87 | tmp = back + 1; |
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88 | |
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89 | while (tmp <= right) |
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90 | { |
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91 | if (matrix.Get(tmp - left,back - left)) break; |
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92 | else tmp++; |
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93 | } |
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94 | |
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95 | if (tmp > right) |
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96 | { |
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97 | if (matrix.Set(pos - left,back - left,(vp)1) || |
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98 | matrix.Set(back - left,pos - left,(vp)1)) error = 3; |
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99 | else |
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100 | { |
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101 | if (last >= 0) mark.Del(last--); |
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102 | |
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103 | if (last < 0) last = mark.Add((vp)pos); |
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104 | else if ((back - (long)mark[last]) > 1) last = mark.Add((vp)pos); |
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105 | |
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106 | break; |
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107 | } |
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108 | } |
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109 | } |
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110 | |
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111 | if (back == backend) |
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112 | { |
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113 | if (last >= 0) mark.Del(last--); |
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114 | |
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115 | if (last > 0) backend = (long)mark[last - 1] + 1; |
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116 | else backend = left; |
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117 | } |
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118 | |
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119 | back--; |
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120 | } |
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121 | } |
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122 | else error = 1; |
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123 | |
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124 | increment = -1; |
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125 | count--; |
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126 | } |
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127 | |
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128 | pos++; |
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129 | } |
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130 | |
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131 | return error; |
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132 | } |
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133 | |
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134 | // ----------------------------------------------------------------------------- |
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135 | int intcmp ( const void *a, |
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136 | const void *b ) |
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137 | // ----------------------------------------------------------------------------- |
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138 | { |
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139 | int res = 0, |
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140 | diff = *(int*)a - *(int*)b; |
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141 | |
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142 | if (diff < 0) res = -1; |
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143 | else if (diff > 0) res = 1; |
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144 | |
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145 | return res; |
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146 | } |
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147 | |
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148 | // ----------------------------------------------------------------------------- |
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149 | int hmatchcmp ( const void *a, |
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150 | const void *b ) |
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151 | // ----------------------------------------------------------------------------- |
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152 | { |
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153 | int res = 0, |
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154 | diff = (*(HMatch**)a)->first - (*(HMatch**)b)->first; |
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155 | |
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156 | if (diff < 0) res = -1; |
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157 | else if (diff > 0) res = 1; |
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158 | |
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159 | return res; |
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160 | } |
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161 | |
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162 | // ----------------------------------------------------------------------------- |
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163 | void hmatchdump ( vp val ) |
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164 | // ----------------------------------------------------------------------------- |
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165 | { |
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166 | HMatch *m = (HMatch*)val; |
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167 | |
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168 | if (m) cout << " " << m->first << ", " << m->last; |
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169 | } |
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170 | |
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171 | // ----------------------------------------------------------------------------- |
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172 | HMatch &A3Helix::GetPart ( int part ) |
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173 | // ----------------------------------------------------------------------------- |
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174 | { |
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175 | HMatch *area = NULL; |
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176 | int parts = Parts(); |
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177 | |
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178 | if ((part >= 0) && (part < parts)) |
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179 | { |
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180 | int anz = match.Elements(), |
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181 | beg = !!(((HMatch*)match[0])->first), |
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182 | end = (((HMatch*)match[anz - 1])->last == (length - 1)), |
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183 | pos = 0; |
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184 | |
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185 | area = new HMatch; |
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186 | parts = 0; |
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187 | |
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188 | while (pos <= anz) |
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189 | { |
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190 | if (!pos) |
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191 | { |
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192 | area->first = 0; |
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193 | |
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194 | if (beg) area->last = ((HMatch*)match[pos])->last; |
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195 | else area->last = ((HMatch*)match[pos + 1])->last; |
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196 | } |
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197 | else if (pos == anz) |
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198 | { |
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199 | if (!beg) break; |
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200 | |
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201 | area->first = ((HMatch*)match[pos - 1])->first; |
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202 | area->last = length - 1; |
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203 | } |
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204 | else if (pos == (anz - 1)) |
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205 | { |
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206 | if (beg) |
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207 | { |
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208 | area->first = ((HMatch*)match[pos - 1])->first; |
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209 | area->last = ((HMatch*)match[pos])->last; |
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210 | } |
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211 | |
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212 | if (end) break; |
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213 | |
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214 | if (!beg) |
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215 | { |
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216 | area->first = ((HMatch*)match[pos])->first; |
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217 | area->last = length - 1; |
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218 | } |
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219 | } |
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220 | else |
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221 | { |
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222 | if (beg) |
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223 | { |
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224 | area->first = ((HMatch*)match[pos - 1])->first; |
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225 | area->last = ((HMatch*)match[pos])->last; |
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226 | } |
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227 | else |
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228 | { |
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229 | area->first = ((HMatch*)match[pos])->first; |
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230 | area->last = ((HMatch*)match[pos + 1])->last; |
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231 | } |
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232 | } |
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233 | |
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234 | if (parts == part) break; |
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235 | |
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236 | parts++; |
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237 | pos++; |
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238 | } |
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239 | } |
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240 | |
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241 | return *area; |
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242 | } |
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243 | |
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244 | // ----------------------------------------------------------------------------- |
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245 | A3Helix::A3Helix ( void ) : match() |
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246 | // ----------------------------------------------------------------------------- |
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247 | { |
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248 | helix = |
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249 | consensus = NULL; |
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250 | length = 0; |
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251 | |
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252 | match.Free(DARRAY_NOFREE); |
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253 | match.Null(DARRAY_NONULL); |
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254 | match.Sort(intcmp); |
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255 | } |
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256 | |
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257 | // ----------------------------------------------------------------------------- |
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258 | A3Helix::A3Helix ( str hel, |
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259 | str kon, |
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260 | DArray &mat ) : match(mat) |
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261 | // ----------------------------------------------------------------------------- |
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262 | { |
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263 | helix = CleanHelix(hel); |
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264 | consensus = strdup(kon); |
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265 | length = strlen(helix); |
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266 | } |
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267 | |
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268 | // ----------------------------------------------------------------------------- |
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269 | A3Helix::~A3Helix ( void ) |
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270 | // ----------------------------------------------------------------------------- |
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271 | { |
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272 | if (helix) delete helix; |
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273 | if (consensus) delete consensus; |
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274 | } |
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275 | |
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276 | // ----------------------------------------------------------------------------- |
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277 | void A3Helix::Set ( DArray &mat ) |
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278 | // ----------------------------------------------------------------------------- |
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279 | { |
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280 | match = mat; |
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281 | } |
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282 | |
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283 | // ----------------------------------------------------------------------------- |
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284 | int A3Helix::Parts ( void ) |
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285 | // ----------------------------------------------------------------------------- |
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286 | { |
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287 | int anz = match.Elements(), |
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288 | parts = anz; |
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289 | |
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290 | if (parts) |
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291 | { |
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292 | parts++; |
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293 | |
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294 | if (!((HMatch*)match[0])->first) parts--; |
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295 | if (((HMatch*)match[anz - 1])->last == (length - 1)) parts--; |
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296 | } |
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297 | |
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298 | return parts; |
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299 | } |
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300 | |
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301 | // ----------------------------------------------------------------------------- |
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302 | DArray &A3Helix::Helices ( int part, |
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303 | int minlen ) |
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304 | // ----------------------------------------------------------------------------- |
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305 | { |
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306 | DArray *helices = new DArray; |
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307 | HMatch &area = GetPart(part); |
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308 | int len = area.last - area.first + 1; |
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309 | A3Matrix mat(len,DARRAY_NOFREE); |
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310 | |
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311 | if (!FindHelices(helix,area.first,area.last,mat)) mat.Dump(NULL); |
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312 | |
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313 | delete &area; |
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314 | |
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315 | return *helices; |
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316 | } |
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317 | |
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318 | // ----------------------------------------------------------------------------- |
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319 | void A3Helix::Dump ( int all ) |
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320 | // ----------------------------------------------------------------------------- |
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321 | { |
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322 | if (all) |
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323 | { |
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324 | cout << "\nhelix = " << helix; |
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325 | // cout << "\n\nkonsensus = " << konsensus; |
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326 | cout << "\n\nlength = " << length; |
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327 | |
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328 | cout << "\n"; |
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329 | } |
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330 | |
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331 | match.Dump(hmatchdump); |
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332 | } |
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